2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-1-(3-chloranyl-2-methyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-1-(3-chloranyl-2-methyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-(3-chloro-2-methyl-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-methyl-2-thiophenyl)-1-(3-chloro-2-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-methylthiophen-2-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-(3-chloro-2-methyl-phenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H19BrClN3OS MolecularWeight: 488.82776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N)C#N)C4=CC(=C(S4)C)Br)C(=O)CCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N)C#N)C4=CC(=C(S4)C)Br)C(=O)CCC3

InChI

InChI=1S/C22H19BrClN3OS/c1-11-15(24)5-3-6-16(11)27-17-7-4-8-18(28)21(17)20(13(10-25)22(27)26)19-9-14(23)12(2)29-19/h3,5-6,9,20H,4,7-8,26H2,1-2H3